[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 3-acetamidobenzoate

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 3-acetamidobenzoate Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C20H16N4O4 MolecularWeight: 376.36544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=O)N2CC#N

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3C(=O)N2CC#N

InChI

InChI=1S/C20H16N4O4/c1-13(25)22-15-6-4-5-14(11-15)20(27)28-12-18-23-17-8-3-2-7-16(17)19(26)24(18)10-9-21/h2-8,11H,10,12H2,1H3,(H,22,25)